Name: 3-(2-propylpentanoyloxy)propanoic acid
SMILES:
CCCC(CCC)C(=O)OCCC(=O)OMolecular Processing
Molecular formula
C11H20O4
Molecular weight
216.28
Exact mass
216.1362
XLogP
2.22
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
15
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.818
Molar refractivity
56.52
Supplementary Information
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Involved in 5 reactions→